[4-[(E)-2-cyanoethenyl]cyclohexyl] 4-ethylbenzoate

Systemtic Name: [4-[(E)-2-cyanoethenyl]cyclohexyl] 4-ethylbenzoate Openeye Name: [4-[(E)-2-cyanovinyl]cyclohexyl] 4-ethylbenzoate CAS Name: 4-ethylbenzoic acid [4-[(E)-2-cyanoethenyl]cyclohexyl] ester IUPAC Name: [4-[(E)-2-cyanoethenyl]cyclohexyl] 4-ethylbenzoate Traditional Name: 4-ethylbenzoic acid [4-[(E)-2-cyanovinyl]cyclohexyl] ester Formula: C18H21NO2 MolecularWeight: 283.36484

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)OC2CCC(CC2)C=CC#N

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)OC2CCC(CC2)/C=C/C#N

InChI

InChI=1S/C18H21NO2/c1-2-14-5-9-16(10-6-14)18(20)21-17-11-7-15(8-12-17)4-3-13-19/h3-6,9-10,15,17H,2,7-8,11-12H2,1H3/b4-3+